| CAS Number | 1050508-87-6 |
| Catalog Number | AG0090N5(AGN-PC-0WBU9V) |
| Chemical Name | [2-(3-fluorophenoxy)ethyl](methyl)amine hydrochloride |
| IUPAC Name | 2-(3-fluorophenoxy)-N-methylethanamine;hydrochloride |
| InChI | InChI=1S/C9H12FNO.ClH/c1-11-5-6-12-9-4-2-3-8(10)7-9;/h2-4,7,11H,5-6H2,1H3;1H |
| InChI Key | YVHCGBUSVQQYAQ-UHFFFAOYSA-N |
| MDL Number | MFCD08721749 |
| Molecular Formula | C9H13ClFNO |
| Molecular Weight | 205.6570 |
| SMILES | Cl.CNCCOC1=CC(F)=CC=C1 |
| Synonyms | 2-(3-Fluorophenoxy)-N-methyl-1-ethanamine hydrochloride,
1050508-87-6,
[2-(3-fluorophenoxy)ethyl]methylamine hydrochloride,
ARONIS013444,
CTK6I5704,
8126AC,
AKOS005111282,
MCULE-6774505795,
BB0290355,
ST45050152,
KS-00004441,
[2-(3-fluorophenoxy)ethyl]methylamine, chloride,
[2-(3-fluorophenoxy)ethyl](methyl)amine hydrochloride,
2-(3-Fluorophenoxy)-N-methyl-1-ethanaminehydrochloride,
2-(3-fluorophenoxy)-N-methylethan-1-amine hydrochloride,
F3377-0289,
C9H13ClFNO,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.657g/mol |
| Monoisotopic Mass | 205.067g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number